2-[(1,3-benzothiazol-2-yl)amino]-4-phenylpyrimidine-5-carbonitrile
Chemical Structure Depiction of
2-[(1,3-benzothiazol-2-yl)amino]-4-phenylpyrimidine-5-carbonitrile
2-[(1,3-benzothiazol-2-yl)amino]-4-phenylpyrimidine-5-carbonitrile
Compound characteristics
| Compound ID: | Y020-5940 |
| Compound Name: | 2-[(1,3-benzothiazol-2-yl)amino]-4-phenylpyrimidine-5-carbonitrile |
| Molecular Weight: | 329.38 |
| Molecular Formula: | C18 H11 N5 S |
| Smiles: | C(c1cnc(Nc2nc3ccccc3s2)nc1c1ccccc1)#N |
| Stereo: | ACHIRAL |
| logP: | 4.4456 |
| logD: | 4.4456 |
| logSw: | -4.5355 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.694 |
| InChI Key: | FNCBFTNYQSNRLI-UHFFFAOYSA-N |